SCHEMBL8008207

SCHEMBL8008207

[C]1=CC=CC1c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.43
MTNR1A P48039 2/20 0.40
SLC6A4 P31645 6/20 0.37
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 4/20 0.36
CYP2A6 P11509 3/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A3 Q01959 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP2 O95551 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
GALK1 P51570 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11023640 0.71 KDM1A (0.48) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL7481203 0.70 KDM1A (0.38) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL7564380 0.66 RECQL (0.33) KDM1ACYP2A6SLC6A2SLC6A3TSHR
SCHEMBL28596276 0.65 KDM1A (0.43) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL5329929 0.65 KDM1A (0.47) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL5527594 0.65 KDM1A (0.39) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL248440 0.64 SLC6A4 (0.59) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL30477104 0.64 SLC6A4 (0.59) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL8658829 0.64 KDM1A (0.42) KDM1AMTNR1ASLC6A4IDO1ALDH1A1
SCHEMBL694466 0.64 KDM1A (0.50) KDM1AMTNR1ASLC6A4IDO1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0970964-A2 Method for producing titanium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed